diethyl 2-[1-[(3aR,4S,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-6-azanyl-4-oxidanylidene-3-prop-2-enyl-5H-imidazo[4,5-c]pyridin-2-ylidene]propanedioate

Systemtic Name: diethyl 2-[1-[(3aR,4S,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-6-azanyl-4-oxidanylidene-3-prop-2-enyl-5H-imidazo[4,5-c]pyridin-2-ylidene]propanedioate Openeye Name: diethyl 2-[1-[(3aR,4S,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-3-allyl-6-amino-4-oxo-5H-imidazo[4,5-c]pyridin-2-ylidene]propanedioate CAS Name: 2-[1-[(3aR,4S,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-6-amino-4-oxo-3-prop-2-enyl-5H-imidazo[4,5-c]pyridin-2-ylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1-[(3aR,4S,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-6-amino-4-oxo-3-prop-2-enyl-5H-imidazo[4,5-c]pyridin-2-ylidene]propanedioate Traditional Name: 2-[1-[(3aR,4S,6aR)-2,2-dimethyl-6-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-3-allyl-6-amino-4-keto-5H-imidazo[4,5-c]pyridin-2-ylidene]malonic acid diethyl ester Formula: C24H32N4O9 MolecularWeight: 520.53228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1N(C2=C(N1C3C4C(C(O3)CO)OC(O4)(C)C)C=C(NC2=O)N)CC=C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C1N(C2=C(N1[C@@H]3[C@H]4[C@@H](C(O3)CO)OC(O4)(C)C)C=C(NC2=O)N)CC=C)C(=O)OCC

InChI

InChI=1S/C24H32N4O9/c1-6-9-27-16-12(10-14(25)26-19(16)30)28(20(27)15(22(31)33-7-2)23(32)34-8-3)21-18-17(13(11-29)35-21)36-24(4,5)37-18/h6,10,13,17-18,21,29H,1,7-9,11H2,2-5H3,(H3,25,26,30)/t13?,17-,18-,21+/m1/s1